ethyl 4-({5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carbonyl}amino)piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carbonyl}amino)piperidine-1-carboxylate
ethyl 4-({5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carbonyl}amino)piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E535-0344 |
| Compound Name: | ethyl 4-({5-[(3-methylbenzene-1-sulfinyl)methyl]furan-2-carbonyl}amino)piperidine-1-carboxylate |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C21 H26 N2 O5 S |
| Smiles: | CCOC(N1CCC(CC1)NC(c1ccc(CS(c2cccc(C)c2)=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1357 |
| logD: | 3.1357 |
| logSw: | -3.3583 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.139 |
| InChI Key: | YAHGWSHSMAUXLW-UHFFFAOYSA-N |